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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:Pyrogallol-1-O-sulphate
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Accession:CHEBI:89613 term browser browse the term
Definition:An isoflavone that has formula C6H6O6S.
Synonyms:related_synonym: (2,3-dihydroxyphenyl) hydrogen sulfate;   (2,3-dihydroxyphenyl) hydrogen sulphate;   (2,3-dihydroxyphenyl)oxidanesulfonic acid;   Formula=C6H6O6S;   InChI=1S/C6H6O6S/c7-4-2-1-3-5(6(4)8)12-13(9,10)11/h1-3,7-8H,(H,9,10,11);   InChIKey=NGVLEQPKHLWZLN-UHFFFAOYSA-N;   SMILES=C=1(C(=C(C=CC1)O)O)OS(=O)(=O)O
 xref: HMDB:HMDB0060016;   PMID:22827565

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  CHEBI ontology 0
    chemical entity 0
      atom 0
        nonmetal atom 0
          oxygen atom 0
            oxygen molecular entity 0
              flavonoids 0
                isoflavonoid 0
                  isoflavones 0
                    Pyrogallol-1-O-sulphate 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  oxacycle 0
                                    benzopyran 0
                                      1-benzopyran 0
                                        isoflavonoid 0
                                          isoflavones 0
                                            Pyrogallol-1-O-sulphate 0
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